#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fm1 s LEU 8 N 0.00 4.24 0.08 -4.42 1.43 -1.26 -4.99 118.68 113.76 1fm1 s LEU 8 Ca 0.00 1.63 -0.26 0.00 -1.03 0.00 0.00 54.13 54.47 1fm1 s LEU 8 Cb 0.00 -3.55 0.08 0.00 0.03 0.00 0.00 46.19 42.75 1fm1 s LEU 8 CO 0.00 -0.53 0.86 -1.59 0.23 0.00 0.00 176.35 175.32 1fm1 s LYS 9 N 2.25 1.05 0.47 1.70 -2.85 -1.26 -4.15 119.74 116.95 1fm1 s LYS 9 Ca 0.51 -0.47 -0.22 0.00 -1.00 0.00 0.00 55.97 54.78 1fm1 s LYS 9 Cb -0.21 0.43 -0.07 0.00 -2.06 0.00 0.00 37.83 35.92 1fm1 s LYS 9 CO 0.18 -0.47 1.14 -1.58 0.10 0.00 0.00 175.35 174.73 1fm1 s TRP 10 N -3.30 2.89 -2.37 1.78 0.52 -1.26 -4.92 118.94 112.28 1fm1 s TRP 10 Ca 0.07 1.55 0.24 0.00 0.02 0.00 0.00 56.10 57.98 1fm1 s TRP 10 Cb -0.01 -3.33 0.93 0.00 -1.15 0.00 0.00 33.47 29.90 1fm1 s TRP 10 CO -0.05 -1.40 1.66 0.45 0.02 0.00 0.00 176.95 177.63 1fm1 n SER 11 N -0.58 1.52 -3.81 2.95 2.88 -1.26 -4.89 113.62 110.42 1fm1 n SER 11 Ca 0.08 -1.59 -0.11 0.00 -1.33 0.00 0.00 58.87 55.92 1fm1 n SER 11 Cb 0.49 -0.05 -0.08 0.00 -0.75 0.00 0.00 64.21 63.82 1fm1 n SER 11 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 1fm1 s LYS 12 N -1.90 0.75 0.00 -1.46 -2.85 -1.26 -5.03 119.74 108.00 1fm1 s LYS 12 Ca 0.35 -0.62 0.25 0.00 -1.00 0.00 0.00 55.97 54.95 1fm1 s LYS 12 Cb 0.19 0.32 0.88 0.00 -2.06 0.00 0.00 37.83 37.15 1fm1 s LYS 12 CO 0.30 -0.23 1.64 -1.33 0.10 0.00 0.00 175.35 175.82 1fm1 n MET 13 N 0.57 1.74 -3.39 1.78 2.81 -1.26 -4.81 117.12 114.56 1fm1 n MET 13 Ca -0.18 -1.10 -0.39 0.00 -1.81 0.00 0.00 57.70 54.22 1fm1 n MET 13 Cb 0.59 -1.45 -0.09 0.00 -0.71 0.00 0.00 33.22 31.57 1fm1 n MET 13 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 1fm1 s ASN 14 N -1.81 6.29 0.02 7.83 0.02 -1.26 -0.13 114.94 125.90 1fm1 s ASN 14 Ca 0.35 0.33 -0.00 0.00 -1.02 0.00 0.00 52.86 52.52 1fm1 s ASN 14 Cb 0.20 -2.21 -0.02 0.00 0.02 0.00 0.00 41.25 39.23 1fm1 s ASN 14 CO 0.30 -0.17 -0.02 -0.76 0.02 0.00 0.00 177.10 176.48 1fm1 s LEU 15 N 1.94 2.21 0.09 0.60 1.43 -0.66 -4.97 118.68 119.33 1fm1 s LEU 15 Ca 0.16 -0.51 0.03 0.00 -1.03 0.00 0.00 54.13 52.78 1fm1 s LEU 15 Cb -0.16 0.14 -0.04 0.00 0.03 0.00 0.00 46.19 46.17 1fm1 s LEU 15 CO 0.09 -0.32 -0.09 0.42 0.23 0.00 0.00 176.35 176.69 1fm1 s THR 16 N -1.59 0.81 0.11 5.49 -4.23 -1.26 -2.25 115.64 112.72 1fm1 s THR 16 Ca -0.15 -1.66 -0.07 0.00 -1.18 0.00 0.00 61.69 58.64 1fm1 s THR 16 Cb -0.09 -1.36 -0.01 0.00 1.34 0.00 0.00 72.50 72.37 1fm1 s THR 16 CO -0.01 -0.64 0.16 -0.72 -0.54 0.00 0.00 174.62 172.87 1fm1 s TYR 17 N -2.68 0.37 -0.04 3.99 1.13 -1.07 -1.27 117.35 117.78 1fm1 s TYR 17 Ca 0.05 -0.79 -0.01 0.00 -1.41 0.00 0.00 57.07 54.91 1fm1 s TYR 17 Cb -0.01 -0.16 0.03 0.00 -1.10 0.00 0.00 41.96 40.71 1fm1 s TYR 17 CO -0.01 -0.56 0.08 0.50 -2.51 0.00 0.00 175.55 173.05 1fm1 s ARG 18 N -3.92 0.03 -0.43 -3.49 3.52 -1.03 -1.90 118.95 111.72 1fm1 s ARG 18 Ca 0.11 0.26 -0.24 0.00 -0.13 0.00 0.00 55.73 55.73 1fm1 s ARG 18 Cb 0.05 -0.19 0.02 0.00 -1.56 0.00 0.00 34.95 33.28 1fm1 s ARG 18 CO -0.06 -0.15 0.84 0.42 -0.81 0.00 0.00 175.30 175.54 1fm1 s ILE 19 N 1.01 4.60 0.17 4.11 1.01 -1.26 -1.82 121.20 129.01 1fm1 s ILE 19 Ca -0.08 0.68 -0.10 0.00 0.00 0.00 0.00 60.65 61.14 1fm1 s ILE 19 Cb -0.11 -4.34 0.04 0.00 0.01 0.00 0.00 42.46 38.06 1fm1 s ILE 19 CO -0.04 -0.69 1.61 0.58 0.00 0.00 0.00 174.94 176.40 1fm1 h VAL 20 N 5.96 1.27 -2.00 2.92 2.07 -1.46 -3.46 116.25 121.55 1fm1 h VAL 20 Ca -0.24 -1.17 -0.04 0.00 0.82 0.00 0.00 66.70 66.07 1fm1 h VAL 20 Cb 1.08 0.91 -0.19 0.00 -1.52 0.00 0.00 31.29 31.57 1fm1 h VAL 20 CO 0.98 0.42 0.24 0.54 0.02 0.00 0.00 177.57 179.76 1fm1 s ASN 21 N -6.53 -0.62 -0.45 0.57 4.22 -1.26 -5.07 114.94 105.80 1fm1 s ASN 21 Ca -0.12 0.64 -0.17 0.00 -2.14 0.00 0.00 52.86 51.07 1fm1 s ASN 21 Cb 0.13 0.51 0.04 0.00 1.28 0.00 0.00 41.25 43.21 1fm1 s ASN 21 CO 0.85 -0.59 0.47 -0.31 -2.04 0.00 0.00 177.10 175.47 1fm1 s TYR 22 N -1.32 3.16 0.38 1.54 2.02 -1.26 -4.78 117.35 117.10 1fm1 s TYR 22 Ca -0.09 -0.55 -0.26 0.00 -0.37 0.00 0.00 57.07 55.79 1fm1 s TYR 22 Cb -0.00 -3.10 -0.11 0.00 -0.40 0.00 0.00 41.96 38.35 1fm1 s TYR 22 CO 0.08 -0.80 1.25 -2.37 -1.57 0.00 0.00 175.55 172.14 1fm1 n THR 23 N 5.42 2.29 0.11 -0.71 5.66 -1.26 -4.80 114.28 120.99 1fm1 n THR 23 Ca -0.08 -0.50 0.05 0.00 -3.05 0.00 0.00 64.05 60.46 1fm1 n THR 23 Cb 0.46 -1.52 0.24 0.00 -1.55 0.00 0.00 70.33 67.96 1fm1 n THR 23 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1fm1 n PRO 24 N 0.29 0.05 0.19 1.09 -0.04 -1.26 -2.09 135.00 133.23 1fm1 n PRO 24 Ca 0.06 0.52 0.17 0.00 -0.04 0.00 0.00 63.50 64.21 1fm1 n PRO 24 Cb 0.38 -1.67 0.81 0.00 -0.04 0.00 0.00 33.50 32.98 1fm1 n PRO 24 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1fm1 h ASP 25 N 0.00 0.00 -5.27 3.54 3.32 -1.89 -3.43 116.42 112.69 1fm1 h ASP 25 Ca 0.00 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.93 1fm1 h ASP 25 Cb 0.03 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 39.45 1fm1 h ASP 25 CO 0.00 0.00 -0.47 -0.04 -1.72 0.00 0.00 179.24 177.01 1fm1 s MET 26 N -4.69 0.93 0.70 3.56 -1.94 -0.89 -4.79 119.30 112.18 1fm1 s MET 26 Ca -0.05 -1.19 -0.12 0.00 -1.71 0.00 0.00 55.69 52.62 1fm1 s MET 26 Cb 0.16 0.31 0.02 0.00 2.01 0.00 0.00 34.83 37.32 1fm1 s MET 26 CO 0.57 -0.29 1.07 0.95 -0.01 0.00 0.00 175.02 177.31 1fm1 s THR 27 N -3.95 3.70 0.22 2.05 -4.23 -1.26 -4.72 115.64 107.45 1fm1 s THR 27 Ca 0.14 0.60 -0.09 0.00 -1.18 0.00 0.00 61.69 61.17 1fm1 s THR 27 Cb 0.05 -3.21 0.19 0.00 1.34 0.00 0.00 72.50 70.88 1fm1 s THR 27 CO -0.04 -0.67 1.89 0.45 -0.54 0.00 0.00 174.62 175.72 1fm1 h HIS 28 N -0.63 1.08 -0.97 3.99 3.86 -1.93 -2.47 115.15 118.08 1fm1 h HIS 28 Ca -0.44 0.02 0.01 0.00 -1.16 0.00 0.00 60.37 58.80 1fm1 h HIS 28 Cb 1.22 -0.36 -0.05 0.00 1.06 0.00 0.00 27.41 29.28 1fm1 h HIS 28 CO 0.59 0.69 0.64 0.77 0.86 0.00 0.00 177.93 181.49 1fm1 h SER 29 N 1.15 1.11 -0.48 2.45 0.02 -2.00 -0.49 113.55 115.32 1fm1 h SER 29 Ca 0.31 -0.03 -0.09 0.00 -0.84 0.00 0.00 61.79 61.14 1fm1 h SER 29 Cb -0.11 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.14 1fm1 h SER 29 CO -0.06 0.80 -0.07 -0.33 -1.14 0.00 0.00 176.83 176.03 1fm1 h GLU 30 N 1.31 0.89 -0.50 3.45 5.08 -1.82 -2.83 114.58 120.15 1fm1 h GLU 30 Ca 0.36 -0.32 -0.13 0.00 -1.00 0.00 0.00 59.36 58.27 1fm1 h GLU 30 Cb -0.14 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.04 1fm1 h GLU 30 CO -0.08 0.96 -0.18 0.28 -1.00 0.00 0.00 179.01 178.99 1fm1 h VAL 31 N 0.74 1.27 0.66 3.13 2.07 -1.07 -2.50 116.25 120.55 1fm1 h VAL 31 Ca 0.13 -1.35 -0.03 0.00 0.82 0.00 0.00 66.70 66.27 1fm1 h VAL 31 Cb 0.60 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 1fm1 h VAL 31 CO 0.04 0.47 -0.45 -0.33 0.02 0.00 0.00 177.57 177.32 1fm1 h GLU 32 N 0.88 -1.02 0.00 1.57 5.08 -0.99 -2.38 114.58 117.71 1fm1 h GLU 32 Ca 0.12 0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.53 1fm1 h GLU 32 Cb 0.76 0.23 -0.00 0.00 0.50 0.00 0.00 28.75 30.24 1fm1 h GLU 32 CO 0.06 -0.68 -0.11 1.57 -1.00 0.00 0.00 179.01 178.85 1fm1 h LYS 33 N -1.06 0.00 0.15 2.33 5.09 -1.56 -2.54 116.57 118.97 1fm1 h LYS 33 Ca -0.08 0.00 -0.01 0.00 0.09 0.00 0.00 60.65 60.65 1fm1 h LYS 33 Cb 0.87 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.20 1fm1 h LYS 33 CO 0.06 0.11 -0.07 0.00 -2.09 0.00 0.00 179.45 177.45 1fm1 h ALA 34 N 1.89 -0.20 -0.32 0.07 0.00 -0.96 -1.01 119.26 118.74 1fm1 h ALA 34 Ca -0.00 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 1fm1 h ALA 34 Cb 0.22 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1fm1 h ALA 34 CO 0.01 -0.61 -0.33 0.74 0.00 0.00 0.00 179.25 179.06 1fm1 h PHE 35 N -0.20 0.81 -0.51 0.00 0.04 -1.25 -2.79 116.94 113.04 1fm1 h PHE 35 Ca -0.02 -0.21 0.00 0.00 2.80 0.00 0.00 57.97 60.54 1fm1 h PHE 35 Cb 0.15 -0.18 -0.03 0.00 2.20 0.00 0.00 35.95 38.10 1fm1 h PHE 35 CO -0.07 0.93 0.34 0.87 -0.60 0.00 0.00 178.31 179.78 1fm1 h LYS 36 N 0.59 0.67 -1.00 1.51 1.57 -1.23 -1.70 116.57 116.98 1fm1 h LYS 36 Ca 0.06 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.81 1fm1 h LYS 36 Cb 0.84 -0.15 -0.05 0.00 0.08 0.00 0.00 32.23 32.95 1fm1 h LYS 36 CO 0.07 0.45 0.67 0.87 -0.57 0.00 0.00 179.45 180.93 1fm1 h LYS 37 N 0.69 1.32 -0.32 3.15 1.57 -1.08 -0.43 116.57 121.47 1fm1 h LYS 37 Ca 0.19 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1fm1 h LYS 37 Cb -0.08 -0.30 -0.02 0.00 0.08 0.00 0.00 32.23 31.92 1fm1 h LYS 37 CO -0.04 0.87 0.21 0.00 -0.57 0.00 0.00 179.45 179.92 1fm1 h ALA 38 N 1.37 0.40 -0.46 3.86 0.00 -1.06 -1.19 119.26 122.18 1fm1 h ALA 38 Ca 0.37 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 55.14 1fm1 h ALA 38 Cb -0.15 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1fm1 h ALA 38 CO -0.08 -0.13 -0.17 0.74 0.00 0.00 0.00 179.25 179.60 1fm1 h PHE 39 N 0.43 1.01 -0.22 0.00 0.04 -0.92 -2.70 116.94 114.58 1fm1 h PHE 39 Ca 0.12 -0.22 0.00 0.00 2.80 0.00 0.00 57.97 60.67 1fm1 h PHE 39 Cb -0.05 -0.25 -0.01 0.00 2.20 0.00 0.00 35.95 37.85 1fm1 h PHE 39 CO -0.05 0.99 0.14 -0.22 -0.60 0.00 0.00 178.31 178.57 1fm1 h LYS 40 N 0.79 0.29 -0.95 1.51 1.63 -0.69 1.07 116.57 120.22 1fm1 h LYS 40 Ca 0.11 -0.02 0.01 0.00 -0.85 0.00 0.00 60.65 59.91 1fm1 h LYS 40 Cb 0.71 -0.06 -0.05 0.00 -0.60 0.00 0.00 32.23 32.23 1fm1 h LYS 40 CO 0.05 0.19 0.63 0.28 -3.45 0.00 0.00 179.45 177.15 1fm1 h VAL 41 N 0.29 1.24 0.12 2.00 2.07 -1.14 0.15 116.25 120.99 1fm1 h VAL 41 Ca 0.08 -0.44 -0.27 0.00 0.82 0.00 0.00 66.70 66.89 1fm1 h VAL 41 Cb -0.03 -0.15 0.01 0.00 -1.52 0.00 0.00 31.29 29.59 1fm1 h VAL 41 CO -0.02 0.23 -1.21 -0.50 0.02 0.00 0.00 177.57 176.10 1fm1 h TRP 42 N 1.28 0.52 0.00 1.57 4.06 -1.12 -3.21 115.95 119.06 1fm1 h TRP 42 Ca 0.35 -0.37 -0.00 0.00 2.06 0.00 0.00 58.89 60.93 1fm1 h TRP 42 Cb -0.15 -0.03 -0.00 0.00 -1.00 0.00 0.00 29.16 27.99 1fm1 h TRP 42 CO -0.00 1.27 -0.02 0.66 -3.56 0.00 0.00 178.44 176.79 1fm1 h SER 43 N 0.09 0.00 -1.01 -3.49 4.64 0.16 -3.01 113.55 110.93 1fm1 h SER 43 Ca -0.13 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.20 1fm1 h SER 43 Cb 1.93 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.97 1fm1 h SER 43 CO 0.20 0.02 0.67 0.44 -0.87 0.00 0.00 176.83 177.29 1fm1 h ASP 44 N 0.00 1.15 -0.30 4.97 3.32 -0.70 -2.79 116.42 122.07 1fm1 h ASP 44 Ca -0.00 -0.03 -0.05 0.00 0.02 0.00 0.00 57.03 56.97 1fm1 h ASP 44 Cb 0.64 -0.29 -0.03 0.00 0.22 0.00 0.00 39.33 39.87 1fm1 h ASP 44 CO 0.00 0.83 0.00 1.33 -1.72 0.00 0.00 179.24 179.69 1fm1 n VAL 45 N -4.39 2.37 -3.74 -1.35 0.24 -1.18 -4.97 118.33 105.31 1fm1 n VAL 45 Ca 0.12 -2.06 -0.12 0.00 -2.04 0.00 0.00 64.34 60.24 1fm1 n VAL 45 Cb 0.02 -0.28 -0.11 0.00 -1.47 0.00 0.00 33.84 32.00 1fm1 n VAL 45 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1fm1 s THR 46 N -2.93 -0.01 -0.93 3.34 -4.23 -1.05 -4.84 115.64 104.98 1fm1 s THR 46 Ca 0.43 0.05 0.00 0.00 -1.18 0.00 0.00 61.69 60.99 1fm1 s THR 46 Cb 0.36 -0.47 0.00 0.00 1.34 0.00 0.00 72.50 73.73 1fm1 s THR 46 CO 0.07 0.02 0.35 -0.81 -0.54 0.00 0.00 174.62 173.71 1fm1 n PRO 47 N 3.46 0.66 -2.14 3.99 -0.04 -1.26 -4.56 135.00 135.11 1fm1 n PRO 47 Ca -0.18 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 62.87 1fm1 n PRO 47 Cb 0.56 -1.32 -0.03 0.00 -0.04 0.00 0.00 33.50 32.68 1fm1 n PRO 47 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1fm1 s LEU 48 N 0.00 4.42 -0.23 1.53 1.43 -1.26 -4.88 118.68 119.68 1fm1 s LEU 48 Ca 0.00 2.56 -0.06 0.00 -1.03 0.00 0.00 54.13 55.60 1fm1 s LEU 48 Cb 0.00 -3.63 -0.02 0.00 0.03 0.00 0.00 46.19 42.57 1fm1 s LEU 48 CO 0.00 -0.57 0.02 0.20 0.23 0.00 0.00 176.35 176.23 1fm1 s ASN 49 N 0.06 4.75 -0.19 2.29 0.01 0.81 -4.86 114.94 117.82 1fm1 s ASN 49 Ca 0.55 -0.28 -0.04 0.00 -0.71 0.00 0.00 52.86 52.38 1fm1 s ASN 49 Cb -0.39 -1.84 -0.02 0.00 0.41 0.00 0.00 41.25 39.42 1fm1 s ASN 49 CO 0.44 -0.02 -0.04 -0.36 -1.51 0.00 0.00 177.10 175.62 1fm1 s PHE 50 N 1.48 2.98 -0.10 2.20 0.08 -1.26 -1.65 117.98 121.71 1fm1 s PHE 50 Ca 0.06 -0.60 0.04 0.00 0.12 0.00 0.00 56.93 56.54 1fm1 s PHE 50 Cb -0.15 -2.03 -0.00 0.00 -0.57 0.00 0.00 43.02 40.27 1fm1 s PHE 50 CO 0.01 -0.29 -0.24 0.99 -0.10 0.00 0.00 175.22 175.58 1fm1 s THR 51 N 0.94 2.07 -0.00 0.64 2.01 -0.96 -5.02 115.64 115.32 1fm1 s THR 51 Ca 0.00 -1.02 -0.29 0.00 0.31 0.00 0.00 61.69 60.69 1fm1 s THR 51 Cb -0.15 -1.78 -0.03 0.00 0.01 0.00 0.00 72.50 70.55 1fm1 s THR 51 CO 0.01 0.56 0.92 -0.60 -0.69 0.00 0.00 174.62 174.82 1fm1 s ARG 52 N 0.34 4.55 -0.18 4.92 3.52 -1.26 -2.60 118.95 128.24 1fm1 s ARG 52 Ca -0.19 1.32 -0.07 0.00 -0.13 0.00 0.00 55.73 56.66 1fm1 s ARG 52 Cb -0.18 -3.45 -0.04 0.00 -1.56 0.00 0.00 34.95 29.72 1fm1 s ARG 52 CO 0.09 0.00 0.05 -0.51 -0.81 0.00 0.00 175.30 174.12 1fm1 s LEU 53 N 0.86 3.78 0.21 -0.88 1.43 -0.80 -4.95 118.68 118.33 1fm1 s LEU 53 Ca 0.49 0.07 -0.08 0.00 -1.03 0.00 0.00 54.13 53.58 1fm1 s LEU 53 Cb -0.21 -1.95 0.13 0.00 0.03 0.00 0.00 46.19 44.20 1fm1 s LEU 53 CO 0.26 0.18 1.74 0.45 0.23 0.00 0.00 176.35 179.21 1fm1 h HIS 54 N 6.67 1.20 -3.63 0.29 3.86 -1.96 -3.44 115.15 118.15 1fm1 h HIS 54 Ca -0.37 -0.12 -0.18 0.00 -1.16 0.00 0.00 60.37 58.55 1fm1 h HIS 54 Cb 1.17 -0.35 -0.04 0.00 1.06 0.00 0.00 27.41 29.25 1fm1 h HIS 54 CO 0.56 0.94 0.03 -0.51 0.86 0.00 0.00 177.93 179.81 1fm1 s ASP 55 N -6.40 0.61 0.00 2.45 1.01 -1.26 -4.98 116.67 108.10 1fm1 s ASP 55 Ca -0.12 -1.41 0.00 0.00 0.71 0.00 0.00 52.55 51.73 1fm1 s ASP 55 Cb 0.15 0.77 0.00 0.00 1.01 0.00 0.00 42.92 44.85 1fm1 s ASP 55 CO 0.84 -1.52 0.00 0.61 0.21 0.00 0.00 175.17 175.31 1fm1 n GLY 56 N -0.58 -2.41 3.68 0.21 0.00 -1.26 -4.89 105.19 99.94 1fm1 n GLY 56 Ca -0.03 -1.91 -0.38 0.00 0.00 0.00 0.00 46.02 43.70 1fm1 n GLY 56 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fm1 s ILE 57 N -0.31 5.23 0.24 -0.61 1.01 -1.26 -5.02 121.20 120.48 1fm1 s ILE 57 Ca 0.00 0.65 0.09 0.00 0.00 0.00 0.00 60.65 61.39 1fm1 s ILE 57 Cb 0.00 -3.70 -0.04 0.00 0.01 0.00 0.00 42.46 38.73 1fm1 s ILE 57 CO 0.00 0.29 0.01 0.00 0.00 0.00 0.00 174.94 175.23 1fm1 s ALA 58 N 1.10 3.19 0.09 9.38 0.00 -1.26 -5.04 121.76 129.22 1fm1 s ALA 58 Ca 0.18 -1.57 -0.23 0.00 0.00 0.00 0.00 51.96 50.34 1fm1 s ALA 58 Cb -0.14 -0.85 -0.15 0.00 0.00 0.00 0.00 23.12 21.98 1fm1 s ALA 58 CO 0.07 0.32 1.74 -0.44 0.00 0.00 0.00 175.76 177.45 1fm1 h ASP 59 N 2.08 0.01 -3.57 0.00 3.32 -1.82 -3.36 116.42 113.08 1fm1 h ASP 59 Ca -0.45 0.00 -0.72 0.00 0.02 0.00 0.00 57.03 55.88 1fm1 h ASP 59 Cb 1.24 -0.00 -0.32 0.00 0.22 0.00 0.00 39.33 40.47 1fm1 h ASP 59 CO 0.59 0.00 -0.39 -0.63 -1.72 0.00 0.00 179.24 177.10 1fm1 s ILE 60 N -6.19 3.98 -0.16 0.35 1.01 -0.39 -4.40 121.20 115.39 1fm1 s ILE 60 Ca -0.13 -2.16 -0.13 0.00 0.00 0.00 0.00 60.65 58.22 1fm1 s ILE 60 Cb 0.06 -3.62 -0.05 0.00 0.01 0.00 0.00 42.46 38.86 1fm1 s ILE 60 CO 0.66 -0.80 0.28 0.00 0.00 0.00 0.00 174.94 175.08 1fm1 s MET 61 N 0.90 4.25 -0.13 2.79 0.23 -1.26 -2.46 119.30 123.63 1fm1 s MET 61 Ca 0.10 0.07 -0.03 0.00 -1.03 0.00 0.00 55.69 54.80 1fm1 s MET 61 Cb -0.23 -3.43 -0.03 0.00 -1.53 0.00 0.00 34.83 29.62 1fm1 s MET 61 CO -0.03 0.24 -0.03 0.42 -2.03 0.00 0.00 175.02 173.59 1fm1 s ILE 62 N 0.46 3.97 0.10 3.16 1.01 -0.76 -2.33 121.20 126.81 1fm1 s ILE 62 Ca 0.16 -0.35 -0.15 0.00 0.00 0.00 0.00 60.65 60.31 1fm1 s ILE 62 Cb -0.13 -2.71 0.03 0.00 0.01 0.00 0.00 42.46 39.66 1fm1 s ILE 62 CO 0.03 0.53 0.37 -0.94 0.00 0.00 0.00 174.94 174.93 1fm1 s SER 63 N -0.05 -0.19 -0.16 3.58 1.04 -1.08 -1.00 113.70 115.84 1fm1 s SER 63 Ca 0.02 -0.29 -0.08 0.00 0.48 0.00 0.00 55.95 56.08 1fm1 s SER 63 Cb -0.13 0.43 -0.04 0.00 0.10 0.00 0.00 66.02 66.38 1fm1 s SER 63 CO 0.02 -0.77 0.13 -0.36 0.98 0.00 0.00 173.24 173.24 1fm1 s PHE 64 N -3.42 3.50 0.36 5.02 0.40 -1.26 -1.83 117.98 120.74 1fm1 s PHE 64 Ca 0.01 0.42 0.07 0.00 -0.60 0.00 0.00 56.93 56.83 1fm1 s PHE 64 Cb 0.01 -2.05 -0.07 0.00 0.51 0.00 0.00 43.02 41.43 1fm1 s PHE 64 CO -0.09 0.51 -0.02 0.20 0.70 0.00 0.00 175.22 176.51 1fm1 s GLY 65 N -0.33 2.27 0.16 4.36 0.00 0.17 -4.86 107.32 109.09 1fm1 s GLY 65 Ca 0.11 -2.16 0.06 0.00 0.00 0.00 0.00 44.72 42.73 1fm1 s GLY 65 CO 0.01 -2.01 -0.12 -0.42 0.00 0.00 0.00 173.10 170.57 1fm1 s ILE 66 N -2.80 1.35 0.00 0.90 1.01 -1.26 -1.50 121.20 118.90 1fm1 s ILE 66 Ca 0.34 -2.11 0.00 0.00 0.00 0.00 0.00 60.65 58.88 1fm1 s ILE 66 Cb 0.07 -1.91 0.00 0.00 0.01 0.00 0.00 42.46 40.63 1fm1 s ILE 66 CO 0.16 -0.70 0.00 1.17 0.00 0.00 0.00 174.94 175.58 1fm1 n LYS 67 N -0.25 0.00 -2.68 2.79 3.00 -1.26 -3.76 118.16 115.99 1fm1 n LYS 67 Ca -0.10 0.00 -0.41 0.00 -0.00 0.00 0.00 58.31 57.81 1fm1 n LYS 67 Cb 0.60 0.00 -0.05 0.00 0.00 0.00 0.00 35.03 35.59 1fm1 n LYS 67 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.40 175.57 1fm1 s GLU 68 N 0.00 4.71 0.05 1.64 -1.05 -1.26 -3.39 118.70 119.40 1fm1 s GLU 68 Ca 0.00 1.52 -0.02 0.00 -0.15 0.00 0.00 54.97 56.32 1fm1 s GLU 68 Cb 0.00 -3.33 0.01 0.00 -0.44 0.00 0.00 34.13 30.37 1fm1 s GLU 68 CO 0.00 0.25 0.10 -2.39 0.95 0.00 0.00 175.26 174.18 1fm1 n HIS 69 N 2.38 -1.18 -0.42 4.83 1.44 -1.25 -5.05 115.22 115.97 1fm1 n HIS 69 Ca 0.01 -0.25 -0.11 0.00 -2.01 0.00 0.00 57.72 55.37 1fm1 n HIS 69 Cb 0.48 0.12 -0.10 0.00 0.12 0.00 0.00 29.99 30.61 1fm1 n HIS 69 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1fm1 n GLY 70 N -0.07 -2.60 3.77 -1.39 0.00 -1.26 -4.42 105.19 99.22 1fm1 n GLY 70 Ca -0.01 1.19 -0.40 0.00 0.00 0.00 0.00 46.02 46.79 1fm1 n GLY 70 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1fm1 s ASP 71 N -5.49 5.88 0.53 1.61 1.01 -1.26 -4.87 116.67 114.08 1fm1 s ASP 71 Ca -0.12 2.97 0.33 0.00 0.71 0.00 0.00 52.55 56.44 1fm1 s ASP 71 Cb 0.11 -2.66 1.35 0.00 1.01 0.00 0.00 42.92 42.73 1fm1 s ASP 71 CO 0.62 -1.18 1.97 2.19 0.21 0.00 0.00 175.17 178.98 1fm1 h PHE 72 N 2.37 0.00 -3.58 4.23 -5.15 -2.02 -3.41 116.94 109.39 1fm1 h PHE 72 Ca -0.51 0.00 -0.64 0.00 -0.20 0.00 0.00 57.97 56.62 1fm1 h PHE 72 Cb 1.26 0.00 -0.14 0.00 0.22 0.00 0.00 35.95 37.30 1fm1 h PHE 72 CO 0.50 0.00 0.17 -0.47 -2.00 0.00 0.00 178.31 176.51 1fm1 s TYR 73 N -3.64 3.11 1.03 6.09 5.04 -1.26 -5.00 117.35 122.71 1fm1 s TYR 73 Ca 0.01 0.23 -0.17 0.00 -2.44 0.00 0.00 57.07 54.70 1fm1 s TYR 73 Cb 0.09 -3.26 0.23 0.00 0.35 0.00 0.00 41.96 39.37 1fm1 s TYR 73 CO 0.53 -0.74 1.28 -1.25 -1.34 0.00 0.00 175.55 174.03 1fm1 s PRO 74 N 2.82 0.08 0.65 4.97 0.04 -1.26 -4.90 135.00 137.40 1fm1 s PRO 74 Ca 0.25 -0.36 -0.01 0.00 0.04 0.00 0.00 61.00 60.91 1fm1 s PRO 74 Cb -0.14 -1.78 0.08 0.00 0.04 0.00 0.00 34.50 32.70 1fm1 s PRO 74 CO 0.17 -2.80 0.91 -0.06 0.04 0.00 0.00 177.00 175.26 1fm1 s PHE 75 N -3.68 2.36 -1.55 0.56 0.08 -1.22 -5.00 117.98 109.53 1fm1 s PHE 75 Ca 0.74 -0.02 0.21 0.00 0.12 0.00 0.00 56.93 57.97 1fm1 s PHE 75 Cb -0.05 -2.96 0.70 0.00 -0.57 0.00 0.00 43.02 40.15 1fm1 s PHE 75 CO 0.54 -1.33 1.60 -0.40 -0.10 0.00 0.00 175.22 175.53 1fm1 n ASP 76 N -2.67 4.45 0.00 1.36 5.75 -1.26 -4.95 116.55 119.23 1fm1 n ASP 76 Ca 0.11 -2.24 0.00 0.00 -0.01 0.00 0.00 54.79 52.65 1fm1 n ASP 76 Cb 0.60 -0.55 0.00 0.00 -1.03 0.00 0.00 41.12 40.14 1fm1 n ASP 76 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1fm1 n GLY 77 N 1.41 0.19 0.07 6.12 0.00 -1.26 -4.80 105.19 106.92 1fm1 n GLY 77 Ca 0.26 -1.99 -0.12 0.00 0.00 0.00 0.00 46.02 44.17 1fm1 n GLY 77 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1fm1 h PRO 78 N 0.00 -0.03 -7.39 1.61 0.13 -1.97 -3.46 132.00 120.90 1fm1 h PRO 78 Ca 0.00 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.63 1fm1 h PRO 78 Cb 0.00 0.01 0.07 0.00 0.13 0.00 0.00 31.00 31.20 1fm1 h PRO 78 CO 0.00 0.70 0.40 -1.54 -0.23 0.00 0.00 178.00 177.34 1fm1 s SER 79 N -5.97 5.91 0.00 1.44 1.04 -1.26 -4.65 113.70 110.21 1fm1 s SER 79 Ca -0.15 1.27 0.00 0.00 0.48 0.00 0.00 55.95 57.55 1fm1 s SER 79 Cb -0.02 -2.23 0.00 0.00 0.10 0.00 0.00 66.02 63.87 1fm1 s SER 79 CO 0.57 -1.05 0.00 0.61 0.98 0.00 0.00 173.24 174.34 1fm1 n GLY 80 N -2.83 0.73 3.55 7.32 0.00 -1.26 -4.67 105.19 108.03 1fm1 n GLY 80 Ca 0.06 -1.34 -0.38 0.00 0.00 0.00 0.00 46.02 44.36 1fm1 n GLY 80 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fm1 s LEU 81 N 0.00 3.32 0.41 0.99 1.43 -1.26 -4.76 118.68 118.81 1fm1 s LEU 81 Ca 0.00 0.55 0.24 0.00 -1.03 0.00 0.00 54.13 53.90 1fm1 s LEU 81 Cb 0.00 -2.53 0.49 0.00 0.03 0.00 0.00 46.19 44.18 1fm1 s LEU 81 CO 0.00 -2.51 1.66 -0.07 0.23 0.00 0.00 176.35 175.66 1fm1 h LEU 82 N 17.29 0.00 -7.15 1.79 3.38 -1.90 -3.43 115.31 125.28 1fm1 h LEU 82 Ca -0.26 0.00 0.38 0.00 0.09 0.00 0.00 57.88 58.10 1fm1 h LEU 82 Cb 1.19 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.81 1fm1 h LEU 82 CO 1.20 0.00 0.96 0.00 0.09 0.00 0.00 178.44 180.69 1fm1 s ALA 83 N -3.23 -2.49 0.20 1.53 0.00 -1.26 -2.62 121.76 113.90 1fm1 s ALA 83 Ca 0.07 0.83 -0.23 0.00 0.00 0.00 0.00 51.96 52.63 1fm1 s ALA 83 Cb 0.06 0.32 0.05 0.00 0.00 0.00 0.00 23.12 23.56 1fm1 s ALA 83 CO 0.65 -1.07 0.78 -3.38 0.00 0.00 0.00 175.76 172.73 1fm1 s HIS 84 N -2.09 -0.25 0.10 0.00 -3.43 -0.94 -4.97 115.29 103.71 1fm1 s HIS 84 Ca 0.17 -0.10 -0.12 0.00 -0.80 0.00 0.00 55.06 54.20 1fm1 s HIS 84 Cb 0.07 0.65 0.02 0.00 -1.43 0.00 0.00 32.58 31.88 1fm1 s HIS 84 CO -0.06 -1.01 0.30 0.00 -2.00 0.00 0.00 174.74 171.97 1fm1 s ALA 85 N -3.66 -0.59 0.17 -1.38 0.00 -1.26 -1.35 121.76 113.70 1fm1 s ALA 85 Ca 0.09 -0.30 -0.03 0.00 0.00 0.00 0.00 51.96 51.71 1fm1 s ALA 85 Cb -0.04 0.57 -0.05 0.00 0.00 0.00 0.00 23.12 23.60 1fm1 s ALA 85 CO 0.01 -0.56 0.40 -0.06 0.00 0.00 0.00 175.76 175.54 1fm1 s PHE 86 N -3.72 3.48 1.06 0.00 0.40 -1.21 -4.98 117.98 113.00 1fm1 s PHE 86 Ca 0.03 0.50 -0.12 0.00 -0.60 0.00 0.00 56.93 56.74 1fm1 s PHE 86 Cb 0.03 -1.97 0.23 0.00 0.51 0.00 0.00 43.02 41.82 1fm1 s PHE 86 CO -0.11 0.39 1.07 -1.25 0.70 0.00 0.00 175.22 176.02 1fm1 s PRO 87 N -2.95 -0.12 -0.57 0.24 0.04 -1.26 -2.79 135.00 127.59 1fm1 s PRO 87 Ca 0.40 1.00 -0.17 0.00 0.04 0.00 0.00 61.00 62.27 1fm1 s PRO 87 Cb -0.12 -1.63 -0.16 0.00 0.04 0.00 0.00 34.50 32.63 1fm1 s PRO 87 CO 0.27 -3.23 1.62 -0.35 0.04 0.00 0.00 177.00 175.34 1fm1 n PRO 88 N -4.59 0.05 -0.77 0.56 -0.04 -1.26 -3.12 135.00 125.82 1fm1 n PRO 88 Ca 0.06 -0.99 0.00 0.00 -0.04 0.00 0.00 63.50 62.53 1fm1 n PRO 88 Cb 0.54 -2.70 0.00 0.00 -0.04 0.00 0.00 33.50 31.30 1fm1 n PRO 88 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1fm1 n GLY 89 N 5.35 2.10 0.00 0.55 0.00 -1.26 -4.93 105.19 107.00 1fm1 n GLY 89 Ca 0.26 -2.11 0.00 0.00 0.00 0.00 0.00 46.02 44.17 1fm1 n GLY 89 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1fm1 n PRO 90 N -0.69 2.39 -0.38 1.61 -0.02 -1.26 -4.23 135.00 132.42 1fm1 n PRO 90 Ca 0.00 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.46 1fm1 n PRO 90 Cb 0.00 0.00 0.11 0.00 -0.02 0.00 0.00 33.50 33.59 1fm1 n PRO 90 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1fm1 h ASN 91 N 0.00 1.15 -0.58 2.55 2.35 -1.96 -2.54 115.58 116.56 1fm1 h ASN 91 Ca 0.00 -0.03 -0.11 0.00 -0.55 0.00 0.00 56.30 55.61 1fm1 h ASN 91 Cb 0.00 -0.29 -0.02 0.00 0.05 0.00 0.00 38.32 38.06 1fm1 h ASN 91 CO 0.00 0.83 -0.05 1.88 -1.65 0.00 0.00 177.43 178.44 1fm1 h TYR 92 N 1.36 1.17 -3.43 1.19 -1.99 -1.90 -3.45 116.97 109.93 1fm1 h TYR 92 Ca 0.37 -0.22 -0.45 0.00 2.00 0.00 0.00 58.73 60.43 1fm1 h TYR 92 Cb -0.16 -0.30 0.20 0.00 2.00 0.00 0.00 36.73 38.48 1fm1 h TYR 92 CO -0.00 1.05 0.05 0.20 -0.00 0.00 0.00 178.16 179.46 1fm1 s GLY 93 N -3.61 1.56 0.00 3.88 0.00 -0.96 -3.35 107.32 104.84 1fm1 s GLY 93 Ca -0.12 -0.09 0.00 0.00 0.00 0.00 0.00 44.72 44.51 1fm1 s GLY 93 CO 0.86 0.59 0.00 0.61 0.00 0.00 0.00 173.10 175.16 1fm1 n GLY 94 N 0.51 0.58 3.90 0.20 0.00 -1.12 -4.59 105.19 104.67 1fm1 n GLY 94 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 1fm1 n GLY 94 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1fm1 s ASP 95 N -2.28 4.51 -0.15 1.61 -4.77 -1.21 -4.09 116.67 110.29 1fm1 s ASP 95 Ca 0.00 0.76 -0.06 0.00 -3.30 0.00 0.00 52.55 49.95 1fm1 s ASP 95 Cb 0.00 -1.26 0.07 0.00 -1.09 0.00 0.00 42.92 40.64 1fm1 s ASP 95 CO 0.00 -1.90 0.32 0.00 0.70 0.00 0.00 175.17 174.29 1fm1 s ALA 96 N -3.56 -0.77 -0.04 2.11 0.00 -0.98 -3.34 121.76 115.17 1fm1 s ALA 96 Ca 0.62 1.16 -0.01 0.00 0.00 0.00 0.00 51.96 53.73 1fm1 s ALA 96 Cb -0.11 -1.02 -0.04 0.00 0.00 0.00 0.00 23.12 21.96 1fm1 s ALA 96 CO 0.49 -0.55 0.02 -1.01 0.00 0.00 0.00 175.76 174.71 1fm1 s HIS 97 N 2.15 3.16 -0.03 0.00 3.76 -0.45 -2.63 115.29 121.25 1fm1 s HIS 97 Ca -0.03 0.16 0.06 0.00 -0.15 0.00 0.00 55.06 55.10 1fm1 s HIS 97 Cb -0.11 -1.74 -0.01 0.00 1.11 0.00 0.00 32.58 31.82 1fm1 s HIS 97 CO -0.10 0.49 -0.20 -0.06 -0.85 0.00 0.00 174.74 174.01 1fm1 s PHE 98 N -1.01 1.88 -0.15 1.40 0.40 -0.76 -2.22 117.98 117.52 1fm1 s PHE 98 Ca 0.17 -0.43 -0.29 0.00 -0.60 0.00 0.00 56.93 55.78 1fm1 s PHE 98 Cb -0.11 -1.23 -0.01 0.00 0.51 0.00 0.00 43.02 42.18 1fm1 s PHE 98 CO 0.07 -0.09 1.00 -0.51 0.70 0.00 0.00 175.22 176.40 1fm1 s ASP 99 N -0.31 7.18 0.00 1.36 1.01 -1.08 0.45 116.67 125.28 1fm1 s ASP 99 Ca 0.04 1.46 0.23 0.00 0.71 0.00 0.00 52.55 54.98 1fm1 s ASP 99 Cb -0.10 -2.54 1.13 0.00 1.01 0.00 0.00 42.92 42.42 1fm1 s ASP 99 CO 0.00 -0.51 1.76 -0.67 0.21 0.00 0.00 175.17 175.96 1fm1 n ASP 100 N 5.43 0.71 0.19 0.27 -0.08 -0.56 -3.47 116.55 119.04 1fm1 n ASP 100 Ca 0.09 -1.44 0.12 0.00 -1.51 0.00 0.00 54.79 52.05 1fm1 n ASP 100 Cb 0.48 -0.03 0.23 0.00 2.34 0.00 0.00 41.12 44.14 1fm1 n ASP 100 CO 0.00 0.00 0.00 0.44 0.12 0.00 0.00 177.20 177.76 1fm1 h ASP 101 N 0.99 0.00 -2.74 1.67 3.32 -1.89 -3.45 116.42 114.32 1fm1 h ASP 101 Ca 0.00 0.00 -0.44 0.00 0.02 0.00 0.00 57.03 56.61 1fm1 h ASP 101 Cb 0.22 0.00 0.05 0.00 0.22 0.00 0.00 39.33 39.82 1fm1 h ASP 101 CO 0.00 0.00 0.01 -1.61 -1.72 0.00 0.00 179.24 175.92 1fm1 s GLU 102 N -3.19 2.48 -0.44 3.56 8.01 -1.23 -4.72 118.70 123.17 1fm1 s GLU 102 Ca 0.08 -0.69 -0.16 0.00 0.01 0.00 0.00 54.97 54.21 1fm1 s GLU 102 Cb 0.07 -2.43 0.04 0.00 -4.31 0.00 0.00 34.13 27.50 1fm1 s GLU 102 CO 0.65 -0.81 0.40 0.99 0.01 0.00 0.00 175.26 176.50 1fm1 s THR 103 N -2.85 5.17 -0.09 3.63 2.01 -1.26 -5.05 115.64 117.21 1fm1 s THR 103 Ca 0.58 -0.68 -0.24 0.00 0.31 0.00 0.00 61.69 61.65 1fm1 s THR 103 Cb -0.10 -4.05 -0.03 0.00 0.01 0.00 0.00 72.50 68.32 1fm1 s THR 103 CO 0.40 -0.47 0.75 0.26 -0.69 0.00 0.00 174.62 174.87 1fm1 s TRP 104 N 1.88 3.54 0.05 4.92 0.52 -1.26 -3.87 118.94 124.72 1fm1 s TRP 104 Ca 0.08 1.28 -0.06 0.00 0.02 0.00 0.00 56.10 57.42 1fm1 s TRP 104 Cb -0.20 -2.88 -0.01 0.00 -1.15 0.00 0.00 33.47 29.23 1fm1 s TRP 104 CO 0.10 -0.00 0.10 -0.08 0.02 0.00 0.00 176.95 177.09 1fm1 s THR 105 N 1.16 0.14 -1.48 2.01 -1.32 -1.26 -4.47 115.64 110.42 1fm1 s THR 105 Ca 0.39 -1.17 0.24 0.00 -1.21 0.00 0.00 61.69 59.94 1fm1 s THR 105 Cb -0.18 -1.01 0.02 0.00 -1.51 0.00 0.00 72.50 69.83 1fm1 s THR 105 CO 0.18 -0.64 1.26 -1.54 -2.21 0.00 0.00 174.62 171.66 1fm1 n SER 106 N 0.60 1.15 -4.67 8.08 3.41 -1.26 -3.47 113.62 117.47 1fm1 n SER 106 Ca -0.18 -0.93 -0.23 0.00 -0.26 0.00 0.00 58.87 57.27 1fm1 n SER 106 Cb 0.59 0.45 0.11 0.00 -0.26 0.00 0.00 64.21 65.10 1fm1 n SER 106 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1fm1 s SER 107 N -2.73 4.29 -1.35 4.04 0.01 -1.26 -4.96 113.70 111.74 1fm1 s SER 107 Ca 0.16 -0.48 -0.16 0.00 1.31 0.00 0.00 55.95 56.78 1fm1 s SER 107 Cb 0.18 0.15 0.07 0.00 0.21 0.00 0.00 66.02 66.63 1fm1 s SER 107 CO 0.66 -1.91 1.91 -1.20 0.41 0.00 0.00 173.24 173.10 1fm1 n SER 108 N -2.84 4.57 -3.81 2.44 7.64 -1.26 -4.78 113.62 115.58 1fm1 n SER 108 Ca 0.16 -2.90 -0.12 0.00 1.01 0.00 0.00 58.87 57.02 1fm1 n SER 108 Cb 0.61 -1.70 -0.09 0.00 -1.01 0.00 0.00 64.21 62.02 1fm1 n SER 108 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1fm1 s LYS 109 N 3.63 0.66 0.98 1.43 1.02 -1.26 -5.10 119.74 121.10 1fm1 s LYS 109 Ca 0.51 -0.42 0.00 0.00 0.02 0.00 0.00 55.97 56.08 1fm1 s LYS 109 Cb 0.07 0.28 0.00 0.00 -0.52 0.00 0.00 37.83 37.67 1fm1 s LYS 109 CO 0.01 -0.19 0.00 0.41 -0.92 0.00 0.00 175.35 174.66 1fm1 n GLY 110 N 1.01 1.51 3.52 -3.33 0.00 -1.26 -4.00 105.19 102.64 1fm1 n GLY 110 Ca -0.21 -0.30 -0.41 0.00 0.00 0.00 0.00 46.02 45.11 1fm1 n GLY 110 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1fm1 s TYR 111 N 0.00 3.23 0.22 1.61 2.02 -1.25 -5.04 117.35 118.15 1fm1 s TYR 111 Ca 0.00 -0.28 -0.31 0.00 -0.37 0.00 0.00 57.07 56.11 1fm1 s TYR 111 Cb 0.00 -2.50 -0.11 0.00 -0.40 0.00 0.00 41.96 38.95 1fm1 s TYR 111 CO 0.00 -0.40 1.60 1.21 -1.57 0.00 0.00 175.55 176.39 1fm1 s ASN 112 N 1.72 6.48 0.23 2.29 3.84 -1.26 -4.07 114.94 124.16 1fm1 s ASN 112 Ca 0.06 2.79 -0.09 0.00 0.21 0.00 0.00 52.86 55.83 1fm1 s ASN 112 Cb -0.18 -2.61 0.20 0.00 -0.55 0.00 0.00 41.25 38.11 1fm1 s ASN 112 CO 0.10 -0.87 1.90 0.25 -2.79 0.00 0.00 177.10 175.69 1fm1 h LEU 113 N 6.02 0.99 -0.61 3.21 5.85 -1.93 -2.74 115.31 126.09 1fm1 h LEU 113 Ca -0.44 -0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.25 1fm1 h LEU 113 Cb 1.21 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.96 1fm1 h LEU 113 CO 0.87 0.72 0.41 0.15 -0.34 0.00 0.00 178.44 180.25 1fm1 h PHE 114 N 1.17 0.77 0.00 1.25 3.57 -1.89 0.22 116.94 122.03 1fm1 h PHE 114 Ca 0.31 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.85 1fm1 h PHE 114 Cb -0.13 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 38.33 1fm1 h PHE 114 CO -0.01 0.49 -0.08 -0.07 -2.23 0.00 0.00 178.31 176.40 1fm1 h LEU 115 N 0.83 -0.24 -0.39 0.59 -0.00 -1.87 0.09 115.31 114.32 1fm1 h LEU 115 Ca 0.22 0.04 -0.16 0.00 -0.00 0.00 0.00 57.88 57.98 1fm1 h LEU 115 Cb -0.10 0.10 -0.01 0.00 -0.00 0.00 0.00 40.66 40.66 1fm1 h LEU 115 CO -0.05 -0.12 -0.38 0.58 -0.00 0.00 0.00 178.44 178.47 1fm1 h VAL 116 N -0.15 1.27 -0.13 1.22 2.07 -1.41 -2.66 116.25 116.46 1fm1 h VAL 116 Ca 0.03 -1.55 0.02 0.00 0.82 0.00 0.00 66.70 66.03 1fm1 h VAL 116 Cb 0.19 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 1fm1 h VAL 116 CO -0.09 0.52 -0.03 0.00 0.02 0.00 0.00 177.57 178.00 1fm1 h ALA 117 N 0.78 0.09 -0.91 1.67 0.00 -0.26 -2.06 119.26 118.56 1fm1 h ALA 117 Ca 0.06 0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1fm1 h ALA 117 Cb 0.98 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.81 1fm1 h ALA 117 CO 0.09 -0.48 0.60 0.00 0.00 0.00 0.00 179.25 179.47 1fm1 h ALA 118 N 1.12 1.36 -0.01 0.00 0.00 -0.96 -2.74 119.26 118.04 1fm1 h ALA 118 Ca 0.06 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1fm1 h ALA 118 Cb 0.09 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 1fm1 h ALA 118 CO -0.13 0.58 0.01 1.25 0.00 0.00 0.00 179.25 180.96 1fm1 h HIS 119 N 1.22 0.02 -0.96 0.00 6.17 -1.03 -2.45 115.15 118.12 1fm1 h HIS 119 Ca 0.34 -0.00 0.01 0.00 0.71 0.00 0.00 60.37 61.43 1fm1 h HIS 119 Cb -0.12 -0.01 -0.05 0.00 2.52 0.00 0.00 27.41 29.76 1fm1 h HIS 119 CO -0.00 0.13 0.63 1.05 0.71 0.00 0.00 177.93 180.46 1fm1 h GLU 120 N -0.10 1.26 -0.99 5.26 4.11 -1.23 -1.75 114.58 121.14 1fm1 h GLU 120 Ca 0.00 -0.08 0.01 0.00 0.07 0.00 0.00 59.36 59.37 1fm1 h GLU 120 Cb 0.12 -0.28 -0.05 0.00 0.50 0.00 0.00 28.75 29.04 1fm1 h GLU 120 CO -0.00 0.84 0.65 0.74 0.07 0.00 0.00 179.01 181.31 1fm1 h PHE 121 N 1.30 1.25 -0.53 2.06 0.04 -1.31 -0.36 116.94 119.40 1fm1 h PHE 121 Ca 0.35 0.03 0.03 0.00 2.80 0.00 0.00 57.97 61.18 1fm1 h PHE 121 Cb -0.15 -0.42 -0.04 0.00 2.20 0.00 0.00 35.95 37.54 1fm1 h PHE 121 CO 0.00 0.79 0.30 0.78 -0.60 0.00 0.00 178.31 179.58 1fm1 h GLY 122 N 1.35 0.75 1.09 -1.45 0.00 -0.84 -0.67 103.07 103.29 1fm1 h GLY 122 Ca 0.36 -0.22 -0.09 0.00 0.00 0.00 0.00 47.33 47.38 1fm1 h GLY 122 CO -0.08 0.17 0.05 0.45 0.00 0.00 0.00 176.54 177.13 1fm1 h HIS 123 N 0.59 1.19 0.00 5.60 3.86 -1.06 -1.91 115.15 123.41 1fm1 h HIS 123 Ca 0.22 -0.19 -0.01 0.00 -1.16 0.00 0.00 60.37 59.23 1fm1 h HIS 123 Cb 0.07 -0.32 -0.00 0.00 1.06 0.00 0.00 27.41 28.22 1fm1 h HIS 123 CO -0.08 1.02 -0.06 0.66 0.86 0.00 0.00 177.93 180.33 1fm1 h SER 124 N 1.01 0.00 0.41 2.45 4.64 -0.26 0.94 113.55 122.74 1fm1 h SER 124 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1fm1 h SER 124 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1fm1 h SER 124 CO 0.02 0.06 -0.01 0.18 -0.87 0.00 0.00 176.83 176.21 1fm1 n LEU 125 N -3.92 0.07 0.00 5.97 4.77 -0.34 -4.56 117.00 118.99 1fm1 n LEU 125 Ca -0.03 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 1fm1 n LEU 125 Cb 0.15 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 1fm1 n LEU 125 CO 0.30 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.98 1fm1 n GLY 126 N 1.22 0.81 3.83 -0.72 0.00 0.32 -4.54 105.19 106.12 1fm1 n GLY 126 Ca 0.17 -0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 1fm1 n GLY 126 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fm1 s LEU 127 N 0.00 4.00 0.45 0.99 1.43 -0.94 -4.72 118.68 119.89 1fm1 s LEU 127 Ca 0.00 1.50 0.08 0.00 -1.03 0.00 0.00 54.13 54.68 1fm1 s LEU 127 Cb 0.00 -4.31 0.02 0.00 0.03 0.00 0.00 46.19 41.93 1fm1 s LEU 127 CO 0.00 -0.28 0.58 -0.62 0.23 0.00 0.00 176.35 176.25 1fm1 s ASP 128 N -2.21 5.46 0.33 2.29 -1.08 -1.26 -4.37 116.67 115.82 1fm1 s ASP 128 Ca 0.58 -0.56 -0.29 0.00 -0.52 0.00 0.00 52.55 51.76 1fm1 s ASP 128 Cb -0.10 -0.46 -0.11 0.00 -1.46 0.00 0.00 42.92 40.79 1fm1 s ASP 128 CO 0.15 -0.85 1.56 1.41 0.52 0.00 0.00 175.17 177.96 1fm1 n HIS 129 N -1.87 2.95 -3.72 -5.34 8.25 -1.26 -4.93 115.22 109.29 1fm1 n HIS 129 Ca 0.08 0.33 -0.26 0.00 -0.26 0.00 0.00 57.72 57.61 1fm1 n HIS 129 Cb 0.60 -2.58 -0.03 0.00 1.12 0.00 0.00 29.99 29.11 1fm1 n HIS 129 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1fm1 s SER 130 N 0.24 6.36 0.00 0.41 0.15 -0.58 -4.99 113.70 115.29 1fm1 s SER 130 Ca 0.59 0.33 0.24 0.00 0.70 0.00 0.00 55.95 57.82 1fm1 s SER 130 Cb -0.48 -1.98 0.44 0.00 -1.71 0.00 0.00 66.02 62.29 1fm1 s SER 130 CO 0.55 -0.07 1.40 0.29 1.20 0.00 0.00 173.24 176.62 1fm1 n LYS 131 N -0.89 2.23 -3.01 5.44 5.02 -1.26 -4.31 118.16 121.39 1fm1 n LYS 131 Ca -0.06 -1.82 -0.40 0.00 -2.02 0.00 0.00 58.31 54.02 1fm1 n LYS 131 Cb 0.55 -1.47 -0.04 0.00 -0.02 0.00 0.00 35.03 34.04 1fm1 n LYS 131 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1fm1 s ASP 132 N -1.80 7.03 0.40 4.39 -1.08 -1.26 -4.95 116.67 119.40 1fm1 s ASP 132 Ca 0.33 1.24 0.17 0.00 -0.52 0.00 0.00 52.55 53.77 1fm1 s ASP 132 Cb 0.21 -2.43 0.84 0.00 -1.46 0.00 0.00 42.92 40.08 1fm1 s ASP 132 CO 0.31 -0.13 1.85 1.55 0.52 0.00 0.00 175.17 179.26 1fm1 h PRO 133 N 6.76 0.00 -0.00 4.34 0.13 -2.01 -2.40 132.00 138.82 1fm1 h PRO 133 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1fm1 h PRO 133 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1fm1 h PRO 133 CO 0.75 0.33 -0.02 0.41 -0.23 0.00 0.00 178.00 179.25 1fm1 n GLY 134 N -0.32 -0.92 3.84 1.56 0.00 -1.26 -4.82 105.19 103.27 1fm1 n GLY 134 Ca -0.01 -0.23 -0.35 0.00 0.00 0.00 0.00 46.02 45.43 1fm1 n GLY 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fm1 s ALA 135 N -2.18 3.48 0.27 4.61 0.00 -0.90 -4.84 121.76 122.19 1fm1 s ALA 135 Ca 0.40 -0.03 0.05 0.00 0.00 0.00 0.00 51.96 52.38 1fm1 s ALA 135 Cb 0.21 -2.65 0.36 0.00 0.00 0.00 0.00 23.12 21.05 1fm1 s ALA 135 CO 0.40 0.40 1.64 -0.07 0.00 0.00 0.00 175.76 178.13 1fm1 h LEU 136 N 3.20 0.30 -0.33 0.00 3.38 -1.87 -2.71 115.31 117.27 1fm1 h LEU 136 Ca -0.48 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.35 1fm1 h LEU 136 Cb 1.19 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1fm1 h LEU 136 CO 0.66 0.73 0.00 0.23 0.09 0.00 0.00 178.44 180.15 1fm1 n MET 137 N -3.98 0.59 -2.21 1.13 2.81 -1.26 -4.80 117.12 109.41 1fm1 n MET 137 Ca -0.02 0.00 -0.41 0.00 -1.81 0.00 0.00 57.70 55.46 1fm1 n MET 137 Cb 0.53 -1.10 -0.03 0.00 -0.71 0.00 0.00 33.22 31.91 1fm1 n MET 137 CO 0.00 0.00 0.00 0.12 1.51 0.00 0.00 175.97 177.60 1fm1 s PHE 138 N -1.67 3.23 -1.96 2.03 5.36 -1.03 -1.52 117.98 122.43 1fm1 s PHE 138 Ca 0.00 1.27 0.07 0.00 -0.96 0.00 0.00 56.93 57.30 1fm1 s PHE 138 Cb 0.00 -3.61 0.40 0.00 -0.34 0.00 0.00 43.02 39.47 1fm1 s PHE 138 CO 0.00 -1.84 0.88 -0.35 -1.46 0.00 0.00 175.22 172.45 1fm1 n PRO 139 N 2.25 0.20 -5.27 10.12 -0.04 -1.26 -4.64 135.00 136.36 1fm1 n PRO 139 Ca 0.05 0.02 -0.31 0.00 -0.04 0.00 0.00 63.50 63.21 1fm1 n PRO 139 Cb 0.43 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.23 1fm1 n PRO 139 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1fm1 s ILE 140 N -2.04 2.10 0.08 0.52 1.01 -1.26 -5.10 121.20 116.51 1fm1 s ILE 140 Ca 0.10 -1.07 -0.31 0.00 0.00 0.00 0.00 60.65 59.37 1fm1 s ILE 140 Cb 0.05 -1.74 -0.06 0.00 0.01 0.00 0.00 42.46 40.71 1fm1 s ILE 140 CO 0.08 0.58 1.25 -0.47 0.00 0.00 0.00 174.94 176.38 1fm1 s TYR 141 N -0.43 3.39 -0.01 3.97 6.14 -1.26 -5.03 117.35 124.12 1fm1 s TYR 141 Ca 0.05 1.21 -0.01 0.00 0.64 0.00 0.00 57.07 58.96 1fm1 s TYR 141 Cb -0.12 -3.49 0.00 0.00 0.42 0.00 0.00 41.96 38.78 1fm1 s TYR 141 CO 0.01 -1.57 0.02 -0.08 0.64 0.00 0.00 175.55 174.57 1fm1 s THR 142 N 1.02 -0.00 0.20 4.34 -1.32 -1.26 -5.14 115.64 113.49 1fm1 s THR 142 Ca 0.60 0.00 -0.26 0.00 -1.21 0.00 0.00 61.69 60.82 1fm1 s THR 142 Cb -0.32 -0.04 -0.08 0.00 -1.51 0.00 0.00 72.50 70.55 1fm1 s THR 142 CO 0.30 0.00 0.83 -0.47 -2.21 0.00 0.00 174.62 173.07 1fm1 s TYR 143 N 0.01 3.89 0.05 9.09 5.04 -1.26 -5.01 117.35 129.16 1fm1 s TYR 143 Ca -0.00 1.71 0.00 0.00 -2.44 0.00 0.00 57.07 56.34 1fm1 s TYR 143 Cb -0.00 -2.83 -0.03 0.00 0.35 0.00 0.00 41.96 39.45 1fm1 s TYR 143 CO 0.00 0.46 -0.04 -0.08 -1.34 0.00 0.00 175.55 174.55 1fm1 s THR 144 N -1.23 0.32 -0.43 4.34 -1.32 -1.26 -5.10 115.64 110.96 1fm1 s THR 144 Ca 0.39 -1.45 -0.29 0.00 -1.21 0.00 0.00 61.69 59.13 1fm1 s THR 144 Cb -0.23 -1.03 0.01 0.00 -1.51 0.00 0.00 72.50 69.74 1fm1 s THR 144 CO 0.27 -0.73 1.39 -0.83 -2.21 0.00 0.00 174.62 172.51 1fm1 s GLY 145 N -2.30 1.09 0.00 6.08 0.00 -1.26 -4.84 107.32 106.09 1fm1 s GLY 145 Ca -0.02 -0.23 0.28 0.00 0.00 0.00 0.00 44.72 44.76 1fm1 s GLY 145 CO -0.05 2.75 2.04 0.28 0.00 0.00 0.00 173.10 178.12 1fm1 n LYS 146 N 8.11 0.91 -0.36 2.90 5.02 -1.26 -3.23 118.16 130.26 1fm1 n LYS 146 Ca 0.16 0.00 -0.03 0.00 -2.02 0.00 0.00 58.31 56.42 1fm1 n LYS 146 Cb 0.48 -1.49 0.10 0.00 -0.02 0.00 0.00 35.03 34.11 1fm1 n LYS 146 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1fm1 h SER 147 N 0.00 1.10 -0.10 4.39 0.87 -2.06 -3.30 113.55 114.46 1fm1 h SER 147 Ca 0.00 -0.03 -0.19 0.00 -1.23 0.00 0.00 61.79 60.34 1fm1 h SER 147 Cb 0.00 -0.28 -0.39 0.00 -0.44 0.00 0.00 62.40 61.29 1fm1 h SER 147 CO 0.00 0.80 -1.06 1.41 -0.53 0.00 0.00 176.83 177.45 1fm1 n HIS 148 N -4.41 0.28 -2.67 2.24 8.25 -1.24 -5.08 115.22 112.58 1fm1 n HIS 148 Ca 0.11 -0.87 -0.42 0.00 -0.26 0.00 0.00 57.72 56.29 1fm1 n HIS 148 Cb 0.01 -0.17 -0.03 0.00 1.12 0.00 0.00 29.99 30.92 1fm1 n HIS 148 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 1fm1 s PHE 149 N -0.85 3.64 0.05 4.41 2.19 -1.20 -5.04 117.98 121.18 1fm1 s PHE 149 Ca 0.32 1.65 0.03 0.00 0.33 0.00 0.00 56.93 59.27 1fm1 s PHE 149 Cb 0.37 -3.16 -0.02 0.00 -1.31 0.00 0.00 43.02 38.90 1fm1 s PHE 149 CO -0.14 -0.17 -0.10 -1.64 1.83 0.00 0.00 175.22 175.00 1fm1 s MET 150 N 0.98 0.64 0.08 10.12 -1.94 -1.26 -5.02 119.30 122.91 1fm1 s MET 150 Ca 0.53 -0.80 -0.36 0.00 -1.71 0.00 0.00 55.69 53.35 1fm1 s MET 150 Cb -0.22 -0.51 -0.15 0.00 2.01 0.00 0.00 34.83 35.95 1fm1 s MET 150 CO 0.28 0.11 1.50 1.28 -0.01 0.00 0.00 175.02 178.18 1fm1 n LEU 151 N 1.49 2.41 -4.59 -0.03 4.77 -1.26 -4.94 117.00 114.84 1fm1 n LEU 151 Ca -0.22 1.09 -0.30 0.00 -0.03 0.00 0.00 56.01 56.56 1fm1 n LEU 151 Cb 0.55 -1.30 0.24 0.00 -2.33 0.00 0.00 43.42 40.58 1fm1 n LEU 151 CO 0.21 -0.63 0.62 -2.16 -1.33 0.00 0.00 177.39 174.10 1fm1 s PRO 152 N 1.09 -1.19 0.23 3.23 0.04 -1.26 -4.71 135.00 132.43 1fm1 s PRO 152 Ca 0.84 -0.04 -0.07 0.00 0.04 0.00 0.00 61.00 61.76 1fm1 s PRO 152 Cb -0.83 -1.60 0.19 0.00 0.04 0.00 0.00 34.50 32.30 1fm1 s PRO 152 CO 0.45 -3.69 1.83 -0.44 0.04 0.00 0.00 177.00 175.18 1fm1 h ASP 153 N -2.57 1.12 -0.33 6.66 3.32 -1.99 -1.21 116.42 121.43 1fm1 h ASP 153 Ca -0.45 -0.13 0.05 0.00 0.02 0.00 0.00 57.03 56.52 1fm1 h ASP 153 Cb 1.30 -0.29 -0.04 0.00 0.22 0.00 0.00 39.33 40.51 1fm1 h ASP 153 CO 0.35 0.94 0.06 -0.78 -1.72 0.00 0.00 179.24 178.08 1fm1 h ASP 154 N 1.23 -0.01 -0.36 6.45 1.82 -2.00 0.10 116.42 123.66 1fm1 h ASP 154 Ca 0.30 0.06 -0.16 0.00 -0.39 0.00 0.00 57.03 56.83 1fm1 h ASP 154 Cb 0.10 0.08 -0.00 0.00 0.68 0.00 0.00 39.33 40.19 1fm1 h ASP 154 CO -0.04 0.03 -0.42 0.44 -1.61 0.00 0.00 179.24 177.65 1fm1 h ASP 155 N 0.17 1.00 -0.28 2.28 3.32 -1.85 -2.64 116.42 118.41 1fm1 h ASP 155 Ca 0.16 -0.47 0.00 0.00 0.02 0.00 0.00 57.03 56.74 1fm1 h ASP 155 Cb 0.18 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.43 1fm1 h ASP 155 CO -0.21 1.27 0.18 0.58 -1.72 0.00 0.00 179.24 179.34 1fm1 h VAL 156 N 0.75 1.08 -0.98 -1.35 2.07 -0.67 -0.56 116.25 116.58 1fm1 h VAL 156 Ca 0.05 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1fm1 h VAL 156 Cb 1.01 0.68 -0.05 0.00 -1.52 0.00 0.00 31.29 31.42 1fm1 h VAL 156 CO 0.10 0.08 0.63 1.56 0.02 0.00 0.00 177.57 179.96 1fm1 h GLN 157 N 0.38 1.31 0.24 1.57 1.08 -0.78 -0.89 115.11 118.01 1fm1 h GLN 157 Ca 0.10 -0.09 -0.01 0.00 -1.45 0.00 0.00 58.65 57.20 1fm1 h GLN 157 Cb -0.03 -0.29 0.00 0.00 -0.05 0.00 0.00 27.48 27.12 1fm1 h GLN 157 CO -0.02 0.88 -0.12 0.78 -0.95 0.00 0.00 178.83 179.41 1fm1 h GLY 158 N 1.34 -0.34 1.02 3.46 0.00 -1.07 -1.86 103.07 105.63 1fm1 h GLY 158 Ca 0.36 0.12 0.01 0.00 0.00 0.00 0.00 47.33 47.82 1fm1 h GLY 158 CO -0.07 -0.12 0.66 1.19 0.00 0.00 0.00 176.54 178.19 1fm1 h ILE 159 N -0.82 1.26 -0.75 2.60 6.09 -1.09 -1.92 117.51 122.87 1fm1 h ILE 159 Ca -0.03 -0.47 -0.06 0.00 -1.37 0.00 0.00 64.86 62.92 1fm1 h ILE 159 Cb 0.51 -0.21 -0.03 0.00 0.47 0.00 0.00 36.82 37.56 1fm1 h ILE 159 CO 0.05 0.25 0.24 1.56 -3.07 0.00 0.00 178.15 177.18 1fm1 h GLN 160 N 1.36 1.17 -0.17 2.19 4.20 -1.19 0.88 115.11 123.55 1fm1 h GLN 160 Ca 0.37 -0.25 0.04 0.00 0.06 0.00 0.00 58.65 58.87 1fm1 h GLN 160 Cb -0.15 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.45 1fm1 h GLN 160 CO -0.08 0.99 0.12 0.66 -0.67 0.00 0.00 178.83 179.85 1fm1 h SER 161 N 1.12 0.02 0.00 1.46 4.64 -0.54 0.82 113.55 121.07 1fm1 h SER 161 Ca 0.24 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 1fm1 h SER 161 Cb 0.31 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1fm1 h SER 161 CO -0.01 0.01 -0.02 -0.07 -0.87 0.00 0.00 176.83 175.88 1fm1 h LEU 162 N 0.02 0.00 0.00 5.97 3.38 -0.94 -3.42 115.31 120.33 1fm1 h LEU 162 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1fm1 h LEU 162 Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1fm1 h LEU 162 CO -0.00 0.03 -0.53 -1.22 0.09 0.00 0.00 178.44 176.80 1fm1 n TYR 163 N -2.31 0.17 -0.18 1.13 4.02 0.20 -5.06 117.16 115.13 1fm1 n TYR 163 Ca -0.00 0.05 0.00 0.00 -0.01 0.00 0.00 57.90 57.94 1fm1 n TYR 163 Cb 0.01 -0.39 0.00 0.00 -0.02 0.00 0.00 39.34 38.94 1fm1 n TYR 163 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26